Mol:FL5F2ANS0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
22 24 0 0 0 0 0 0 0 0999 V2000
-1.0716 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0716 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7861 0.6186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7861 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3573 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7862 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7861 1.8564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0716 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 -1.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2151 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0718 -1.0314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2151 1.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7851 -0.6195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1470 -0.9921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
2 3 1 0 0 0 0
3 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 1 1 0 0 0 0
1 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 2 0 0 0 0
9 10 1 0 0 0 0
10 2 1 0 0 0 0
9 11 1 0 0 0 0
11 12 2 0 0 0 0
12 13 1 0 0 0 0
13 14 2 0 0 0 0
14 15 1 0 0 0 0
15 16 2 0 0 0 0
16 11 1 0 0 0 0
7 17 2 0 0 0 0
4 18 1 0 0 0 0
8 19 1 0 0 0 0
14 20 1 0 0 0 0
19 21 1 0 0 0 0
5 22 1 0 0 0 0
S SKP 8
ID FL5F2ANS0002
KNApSAcK_ID C00013351
NAME 6,7,4'-Trihydroxy-3-methoxyflavone;6,7-Dihydroxy-2-(4-hydroxyphenyl)-3-methoxy-4H-1-benzopyran-4-one
CAS_RN 159506-37-3
FORMULA C16H12O6
EXACTMASS 300.063388116
AVERAGEMASS 300.26288
SMILES COC(C(=O)2)=C(Oc(c3)c(cc(O)c(O)3)2)c(c1)ccc(O)c1
M END
